CHEMBL1224219
SMILES | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 |
InChIKey | HEKFYWONLKTJOD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 315.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pEC50 | 6.47 | 6.47 | 6.47 | ChEMBL |
HCA2 | HCAR2 | Human | Hydroxycarboxylic acid | A | pIC50 | 7.3 | 7.3 | 7.3 | ChEMBL |
HCA2 | HCAR2 | Rat | Hydroxycarboxylic acid | A | pEC50 | 6.85 | 6.85 | 6.85 | ChEMBL |
HCA2 | HCAR2 | Rat | Hydroxycarboxylic acid | A | pIC50 | 6.19 | 6.19 | 6.19 | ChEMBL |